SCHEMBL11575813

SCHEMBL11575813

Cc1cc(Cl)c(N)cc1NC(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.62
CYP1A2 P05177 1/20 0.62
CYP2C9 P11712 1/20 0.62
CYP2C19 P33261 1/20 0.62
HDAC1 Q13547 5/20 0.55
HDAC2 Q92769 4/20 0.55
HDAC3 O15379 2/20 0.55
POLB P06746 2/20 0.55
TP53 P04637 1/20 0.55
MAPK1 P28482 1/20 0.55
HPGD P15428 1/20 0.55
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
KCNMA1 Q12791 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11314855 0.94 MAPT (0.62) MAPTCYP1A2CYP2C9CYP2C19HDAC1
SCHEMBL11574145 0.87 POLB (0.60) MAPTPOLBHPGDKMT2AMEN1
SCHEMBL11574236 0.86 HDAC1 (0.60) MAPTCYP1A2CYP2C9CYP2C19HDAC1
SCHEMBL8777716 0.86 MAPT (0.68) MAPTCYP1A2CYP2C9CYP2C19HDAC1
SCHEMBL11574057 0.84 LMNA (0.62) MAPTCYP1A2CYP2C19POLBTP53
SCHEMBL9861801 0.83 MAPT (0.68) MAPTCYP1A2CYP2C9CYP2C19HDAC1
SCHEMBL9760053 0.83 HDAC1 (0.60) MAPTCYP1A2CYP2C9CYP2C19HDAC1
SCHEMBL3445622 0.82 MAPT (0.62) MAPTCYP1A2CYP2C9CYP2C19HDAC1
SCHEMBL14900902 0.82 POLB (0.72) MAPTCYP1A2CYP2C9CYP2C19HDAC1
SCHEMBL9492060 0.81 KCNMA1 (0.61) MAPTCYP1A2CYP2C9CYP2C19HDAC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4080321-A COLORFASTNESS HOECHST AKTIENGESELLSCHAFT (DT) 1978-03-21 US disclosed